ATOMPAW is a program to be used for the generation of atomic datasets needed by first-principles simulation software based on the {Projector Augmented-Wave} (PAW) approach, which computes the electronic structure of materials within the Density-Functional theory. ATOMPAW produces, for a given atomic species, a set of basis and projectors functions, as well as some additional atomic data stored in a PAW dataset (text file). PAW datasets can be written in a XML file (conforming to XML-PAW standard) or in several proprietary formats (ABINIT, SOCORRO, Quantum Espresso, ...).

WWW: http://users.wfu.edu/natalie/papers/pwpaw/man.html
